Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | PPARG | P37231 | 5/20 | 0.47 |
| ▸ | F7 | P08709 | 4/20 | 0.47 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.47 |
| ▸ | F3 | P13726 | 4/20 | 0.47 |
| ▸ | PPARD | Q03181 | 4/20 | 0.47 |
| ▸ | PPARA | Q07869 | 4/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | OXER1 | Q8TDS5 | 2/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.47 |
| ▸ | RXRA | P19793 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.45 |
| ▸ | RELA | Q04206 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.44 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.44 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL1101262 | 0.94 | FFAR1 (0.44) | ALDH1A1PPARGF7CYP19A1F3 | |
| SCHEMBL16503990 | 0.94 | ALDH1A1 (0.52) | ALDH1A1PPARGF7CYP19A1F3 | |
| SCHEMBL832707 | 0.94 | FFAR1 (0.44) | ALDH1A1PPARGF7CYP19A1F3 | |
| SCHEMBL17744013 | 0.89 | FFAR1 (0.53) | ALDH1A1PPARGF7CYP19A1F3 | |
| SCHEMBL17744014 | 0.89 | FFAR1 (0.53) | ALDH1A1PPARGF7CYP19A1F3 | |
| SCHEMBL23704055 | 0.89 | FFAR1 (0.53) | ALDH1A1PPARGF7CYP19A1F3 | |
| SCHEMBL16503983 | 0.89 | FFAR1 (0.53) | ALDH1A1PPARGF7CYP19A1F3 | |
| SCHEMBL31436976 | 0.88 | ALDH1A1 (0.42) | ALDH1A1PPARGF7CYP19A1F3 | |
| SCHEMBL6135523 | 0.87 | NFKB1 (0.48) | ALDH1A1PPARGF7CYP19A1F3 | |
| SCHEMBL831776 | 0.87 | NFKB1 (0.48) | ALDH1A1PPARGF7CYP19A1F3 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0017503-B1 | GEM-BIS (HYDROXYMETHYL) ALCOHOLS AND MIXTURES THEREOF WITH DIOLS, PROCESS FOR THEIR PREPARATION AND A PROCESS FOR THE PREPARATION OF POLYURETHANES THEREFROM | HENKEL CORPORATION (a Delaware corp.) (US) | 1982-12-29 | — | — | EP | disclosed |